4-chloranyl-1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazole-3-carboxylic acid

Systemtic Name: 4-chloranyl-1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazole-3-carboxylic acid Openeye Name: 4-chloro-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxylic acid CAS Name: 4-chloro-1-[(2-chloro-4-nitrophenoxy)methyl]-3-pyrazolecarboxylic acid IUPAC Name: 4-chloro-1-[(2-chloro-4-nitrophenoxy)methyl]pyrazole-3-carboxylic acid Traditional Name: 4-chloro-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxylic acid Formula: C11H7Cl2N3O5 MolecularWeight: 332.09638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OCN2C=C(C(=N2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OCN2C=C(C(=N2)C(=O)O)Cl

InChI

InChI=1S/C11H7Cl2N3O5/c12-7-3-6(16(19)20)1-2-9(7)21-5-15-4-8(13)10(14-15)11(17)18/h1-4H,5H2,(H,17,18)